Geometry & MOs

Info

ID:	363239
PubChem CID:	127310380
Reduced:	O2N4C21H30 (1)
Stoich.:	A2B4C21D30 (1)
Weight, g/mol:	390.182254
ΔH_f, kcal/mol:	-50.2
Dipole, Da:	5.64
IP(EA), eV:	-9.08(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-chlorophenyl)-2-methylpropyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(C)(C)CNC(=O)N2CCOC(C2)CN3C=C(C=N3)C

DOS

IR

Vibrations