Geometry & MOs

Info

ID:	196942
PubChem CID:	78899962
Reduced:	O2N3C23H27 (1)
Stoich.:	A2B3C23D27 (1)
Weight, g/mol:	358.169271
ΔH_f, kcal/mol:	6.44
Dipole, Da:	4.39
IP(EA), eV:	-8.82(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclopropyl-[(3-fluorophenyl)methyl]amino]-N-(3,4-dimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CN(CC2CCCO2)CC3=CN(N=C3)C4=CC=CC=C4

DOS

IR

Vibrations