Geometry & MOs

Info

ID:	197842
PubChem CID:	79006317
Reduced:	NOC4H7 (2)
Stoich.:	ABC4D7 (2)
Weight, g/mol:	327.08339
ΔH_f, kcal/mol:	-106.89
Dipole, Da:	4.03
IP(EA), eV:	-9.96(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromo-2-methoxyphenyl)methyl]-2-(cyclopropylmethoxy)-N-methylethanamine

Drug info:

PubChemData

Smile

CCC(C)(C)N1CC(=O)NC1=O

DOS

IR

Vibrations