Geometry & MOs

Info

ID:	352152
PubChem CID:	127283220
Reduced:	O2N4C21H26 (1)
Stoich.:	A2B4C21D26 (1)
Weight, g/mol:	377.210327
ΔH_f, kcal/mol:	-33.46
Dipole, Da:	3.19
IP(EA), eV:	-9.29(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methyl-1,4-diazepane-1-carbonyl)phenyl]-2,3-dihydro-1H-indene-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCCN4C3=CC=N4

DOS

IR

Vibrations