Geometry & MOs

Info

ID:	177282
PubChem CID:	76159190
Reduced:	N3O4C33H41 (1)
Stoich.:	A3B4C33D41 (1)
Weight, g/mol:	431.278407
ΔH_f, kcal/mol:	-113.62
Dipole, Da:	7.21
IP(EA), eV:	-8.74(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-15-yl)cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC1CN(C(COC2=C(C=CC(=C2)NC(=O)CC3=CC=CC=C3)C(=O)N(CC1OC)C)C)CCC4=CC=CC=C4

DOS

IR

Vibrations