Geometry & MOs

Info

ID:	293125
PubChem CID:	117374294
Reduced:	NOC7H10 (2)
Stoich.:	ABC7D10 (2)
Weight, g/mol:	248.163711
ΔH_f, kcal/mol:	-76.96
Dipole, Da:	1.58
IP(EA), eV:	-8.54(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[4-(aminomethyl)-1-methylpyrrolidin-2-yl]phenyl]urea

Drug info:

PubChemData

Smile

CC(CN)C1=CC2=C(C=C1)OC(C(=O)N2C)(C)C

DOS

IR

Vibrations